2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyridin-4-one

Systemtic Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyridin-4-one Openeye Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyridin-4-one CAS Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-1H-pyridin-4-one IUPAC Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-1H-pyridin-4-one Traditional Name: 2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-4-pyridone Formula: C12H16N4OS MolecularWeight: 264.34664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2=CC(=O)C=CN2

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2=CC(=O)C=CN2

InChI

InChI=1S/C12H16N4OS/c1-9-11(16-8-15-9)7-18-5-4-14-12-6-10(17)2-3-13-12/h2-3,6,8H,4-5,7H2,1H3,(H,15,16)(H2,13,14,17)